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Compound Detail

CHEMBL5795542

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NC[C@]1(c2cccc(-c3ncnc4[nH]ccc34)c2)C[C@@H](O)c2ccccc21

Basic Information

ChEMBL ID CHEMBL5795542
Phase Preclinical
Structure Type MOL
InChI Key UAPASVZOUSSSPZ-KNQAVFIVSA-N
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

356.4
MW (Da)
3.31
ALogP
4
HBA
3
HBD
87.8
PSA (Ų)
0.53
QED
0
Ro5 Violations
3
Rot. Bonds

Drug Information

Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C22H20N4O
MW 356.43
Aromatic Rings 4
Heavy Atoms 27
NP-Likeness 0.14

Activity Summary

IC50 1 meas. best 6.12

Target Activity Profile

Target Type Best pChEMBL Mean pChEMBL Best (nM) # Data
Tyrosine-protein kinase receptor TYRO3
CHEMBL5314
IC50 6.12 6.12 750.0 1

Activity Data Samples

Top measurements by pChEMBL value

Data from ChEMBL 36 via Core Engine